2-[2-(3-hexadecanoyloxyoctanoylamino)ethanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[2-(3-hexadecanoyloxyoctanoylamino)ethanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[2-(3-hexadecanoyloxyoctanoylamino)acetyl]amino]-3-hydroxy-propanoic acid CAS Name: 3-hydroxy-2-[[1-oxo-2-[[1-oxo-3-(1-oxohexadecoxy)octyl]amino]ethyl]amino]propanoic acid IUPAC Name: 2-[[2-(3-hexadecanoyloxyoctanoylamino)acetyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[2-(3-hexadecanoyloxyoctanoylamino)acetyl]amino]-3-hydroxy-propionic acid Formula: C29H54N2O7 MolecularWeight: 542.74826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(CCCCC)CC(=O)NCC(=O)NC(CO)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(CCCCC)CC(=O)NCC(=O)NC(CO)C(=O)O

InChI

InChI=1S/C29H54N2O7/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-20-28(35)38-24(19-17-6-4-2)21-26(33)30-22-27(34)31-25(23-32)29(36)37/h24-25,32H,3-23H2,1-2H3,(H,30,33)(H,31,34)(H,36,37)